CID 3025454

2-((2-methoxyphenoxy)methyl)thiazolidine

Structural Information

Molecular Formula
C11H15NO2S
SMILES
COC1=CC=CC=C1OCC2NCCS2
InChI
InChI=1S/C11H15NO2S/c1-13-9-4-2-3-5-10(9)14-8-11-12-6-7-15-11/h2-5,11-12H,6-8H2,1H3
InChIKey
RVDKSQDMEIWCNB-UHFFFAOYSA-N
Compound name
2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

27
Patents

225.08235 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.08963 148.9
[M+Na]+ 248.07157 155.7
[M-H]- 224.07507 152.8
[M+NH4]+ 243.11617 167.4
[M+K]+ 264.04551 152.4
[M+H-H2O]+ 208.07961 142.2
[M+HCOO]- 270.08055 164.9
[M+CH3COO]- 284.09620 182.6
[M+Na-2H]- 246.05702 149.8
[M]+ 225.08180 149.2
[M]- 225.08290 149.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe